%chk=000060784.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060784

0 1
 O  -0.6609000      -1.449300     -0.9885000    
 O   -4.000700      -1.116200     -0.5802000    
 N    3.069600      -1.135000     -0.5771000    
 N    3.929200     -0.1975000       1.243400    
 N   -3.092100      -1.683300       1.447400    
 C    1.364900      0.5094000      -1.347300    
 C   6.5600000E-02  0.8033000     -0.6732000    
 C    2.445600      3.9700001E-02 -0.3946000    
 C  -0.9004000     -0.1910000     -0.5191000    
 C  -0.1763000       2.091000     -0.1944000    
 C   -2.108400      0.1024000      0.1135000    
 C   -1.384300       2.384400      0.4384000    
 C   -2.350300       1.390000      0.5922000    
 C    2.960900      0.6139000      0.7073000    
 C    3.969600      -1.242200      0.4465000    
 C   -3.131800     -0.9196000      0.2857000    
 H    1.220700     -0.2234000      -2.152100    
 H    1.729700       1.412000      -1.856700    
 H   0.5667000       2.876200     -0.3067000    
 H   -1.572600       3.386900      0.8113000    
 H   -3.287900       1.631100       1.086900    
 H    2.916000      -1.811200      -1.314200    
 H    2.711500       1.560500       1.163700    
 H    4.618900      -2.099500      0.5529000    
 H   -1.415500      -2.032300     -0.8069000    
 H   -2.384900      -1.542000       2.161700    
 H   -3.776400      -2.413200       1.615800    


%chk=000060784-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000060784

0 1
O -0.205437 -1.390097 -0.895418
O -2.292477 -2.476056 -0.108840
N 2.533008 -1.147659 -0.225258
N 4.539305 -0.401397 0.502429
N -3.918257 -1.374960 1.086552
C 1.463560 0.898497 -1.307193
C 0.148393 0.974094 -0.533458
C 2.588265 0.208815 -0.572768
C -0.660840 -0.189464 -0.370089
C -0.311734 2.184722 0.019709
C -1.921108 -0.122319 0.317861
C -1.546048 2.270617 0.715005
C -2.343717 1.125385 0.855628
C 3.837010 0.648294 -0.116407
C 3.718479 -1.470557 0.419615
C -2.717809 -1.369751 0.424268
H 1.277430 0.377083 -2.267354
H 1.795585 1.921903 -1.552620
H 0.305279 3.083427 -0.096865
H -1.874440 3.227158 1.132603
H -3.299162 1.212999 1.386772
H 1.704134 -1.723393 -0.415325
H 4.271789 1.642769 -0.196278
H 3.941045 -2.463828 0.801871
H -0.968161 -2.095699 -0.714597
H -4.308064 -0.549718 1.533731
H -4.429627 -2.255764 1.132125


